CHEBI:68234 - myristicin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name myristicin
ChEBI ID CHEBI:68234
Stars This entity has been manually annotated by a third party.
Secondary ChEBI IDs CHEBI:7057
Supplier Information
Download Molfile XML SDF
Formulae C11H12O3
C11H12O3
Net Charge 0
Average Mass 192.21120
Monoisotopic Mass 192.079
InChI InChI=1S/C11H12O3/c1-3-4-8-5-9(12-2)11-10(6-8)13-7-14-11/h3,5-6H,1,4,7H2,2H3
InChIKey BNWJOHGLIBDBOB-UHFFFAOYSA-N
SMILES COc1cc(CC=C)cc2OCOc12
Metabolite of Species Details
Petroselinum crispum (NCBI:txid4043) Found in seed (BTO:0001226). Essential oil of seeds See: PubMed
Myristica fragrans (NCBI:txid51089) Found in fruit (BTO:0000486). See: PubMed
Ligusticum porteri (NCBI:txid54719) Found in root (BTO:0001188). Air-dried and pulverized roots were macerated with CH2Cl2-MeOH(1:1) See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing myristicin (CHEBI:68234) has role metabolite (CHEBI:25212)
myristicin (CHEBI:68234) is a organic molecular entity (CHEBI:50860)
Synonyms Sources
1,3-Benzodioxole, 4-methoxy-6-(2-propenyl)- ChEBI
6-Allyl-4-methoxy-1,3-benzodioxole ChEBI
Benzene, 5-allyl-1-methoxy-2,3-(methylenedioxy)- ChEBI
Myristicin KEGG COMPOUND
Database Links Databases
C00002762 KNApSAcK
C10480 KEGG COMPOUND
View more database links
Registry Numbers Types Sources
607-91-0 CAS Registry Number KEGG COMPOUND
607-91-0 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
20879744 PubMed citation Europe PMC
21049975 PubMed citation Europe PMC
Last Modified
28 July 2014